SCHEMBL13437720

SCHEMBL13437720

CSc1cc(Br)ccc1C=O

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 4/20 0.47
CYP2A6 P11509 3/20 0.41
ALDH1A1 P00352 5/20 0.40
PTPN1 P18031 1/20 0.38
PRKDC P78527 1/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.37
LMNA P02545 1/20 0.34
PIM3 Q86V86 2/20 0.34
PIM1 P11309 1/20 0.33
EGFR P00533 1/20 0.33
ERBB2 P04626 1/20 0.33
CCR2 P41597 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1017248 0.84 ERN1 (0.52) ERN1CYP2A6ALDH1A1PTPN1PRKDC
SCHEMBL31050324 0.84 ERN1 (0.52) ERN1CYP2A6ALDH1A1PTPN1PRKDC
SCHEMBL9952004 0.79 ERN1 (0.43) ERN1CYP2A6ALDH1A1PTPN1PRKDC
SCHEMBL27993122 0.79 ERN1 (0.43) ERN1CYP2A6ALDH1A1PTPN1PRKDC
SCHEMBL22867745 0.79 ALDH1A1 (0.44) ERN1CYP2A6ALDH1A1LMNAPIM3
SCHEMBL2800253 0.78 ALDH1A1 (0.48) ALDH1A1LMNA
SCHEMBL3376315 0.78 ALDH1A1 (0.48) CYP2A6ALDH1A1
SCHEMBL362934 0.76 ALDH1A1 (0.42) ERN1ALDH1A1PTPN1
SCHEMBL4866236 0.76 TDP1 (0.55) ERN1ALDH1A1PTPN1CCR2
SCHEMBL29954894 0.76 TYR (0.43) ERN1ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240150328-A1 METHODS AND COMPOUNDS FOR TREATING DISORDERS FOGHORN THERAPEUTICS INC. 2024-05-09 US disclosed
US-11773085-B2 Methods and compounds for treating disorders FOGHORN THERAPEUTICS INC. (US) 2023-10-03 US disclosed
US-11773085-B2 Methods and compounds for treating disorders FOGHORN THERAPEUTICS INC. (US) 2023-10-03 US disclosed
US-11773085-B2 Methods and compounds for treating disorders FOGHORN THERAPEUTICS INC. (US) 2023-10-03 US disclosed
CN-112236172-A Methods and compounds for treating disorders 福宏治疗公司 2021-01-15 CN disclosed
US-20210009568-A1 METHODS AND COMPOUNDS FOR TREATING DISORDERS FOGHORN THERAPEUTICS INC. 2021-01-14 US disclosed
EP-3746135-A1 METHODS AND COMPOUNDS FOR TREATING DISORDERS Foghorn Therapeutics Inc. (US) 2020-12-09 EP disclosed
WO-2019152440-A1 METHODS AND COMPOUNDS FOR TREATING DISORDERS FOGHORN THERAPEUTICS INC. (US) 2019-08-08 WO disclosed
CN-107873031-A Benzoxazinone derivatives and analogs thereof as modulators of TNF activity UCB生物制药私人有限公司 2018-04-03 CN disclosed
WO-2017193016-A1 ANTIMICROBIALS AND METHODS OF MAKING AND USING SAME MELINTA THERAPEUTICS, INC. (US) 2017-11-09 WO disclosed
WO-2014122160-A1 SUBSTITUTED BICYCLIC DIHYDROPYRIMIDINONES AND THEIR USE AS INHIBITORS OF NEUTROPHIL ELASTASE ACTIVITY BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-08-14 WO disclosed
US-20140221335-A1 SUBSTITUTED BICYCLIC DIHYDROPYRIMIDINONES AND THEIR USE AS INHIBITORS OF NEUTROPHIL ELASTASE ACTIVITY BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-08-07 US disclosed
US-20140221335-A1 SUBSTITUTED BICYCLIC DIHYDROPYRIMIDINONES AND THEIR USE AS INHIBITORS OF NEUTROPHIL ELASTASE ACTIVITY BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-08-07 US disclosed
US-20140038964-A1 IMIDAZOLE BASED LXR MODULATORS EXELIXIS PATENT COMPANY LLC (US) 2014-02-06 US disclosed
US-20140038964-A1 IMIDAZOLE BASED LXR MODULATORS EXELIXIS PATENT COMPANY LLC (US) 2014-02-06 US disclosed
US-8569352-B2 Imidazole based LXR modulators EXELIXIS PATENT COMPANY LLC (US) 2013-10-29 US disclosed
US-8569352-B2 Imidazole based LXR modulators EXELIXIS PATENT COMPANY LLC (US) 2013-10-29 US disclosed
US-20100075964-A1 IMIDAZOLE BASED LXR MODULATORS EXELIXIS, INC. (US) 2010-03-25 US disclosed
US-20100075964-A1 IMIDAZOLE BASED LXR MODULATORS EXELIXIS, INC. (US) 2010-03-25 US disclosed
WO-2007002563-A1 IMIDAZOLE BASED LXR MODULATORS EXELIXIS, INC. (US) 2007-01-04 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140038964-A1 IMIDAZOLE BASED LXR MODULATORS NR1H2, NR1H3, NR1H4 ERN1 2205/4885CYP2A6 176/4885ALDH1A1 3198/4885
US-20100075964-A1 IMIDAZOLE BASED LXR MODULATORS NR1H2, NR1H3, NR1I2 ERN1 1420/4885CYP2A6 81/4885ALDH1A1 2042/4885
US-11773085-B2 Methods and compounds for treating disorders VHL, TFEB, BECN1 ERN1 1427/4885CYP2A6 2721/4885ALDH1A1 2034/4885
US-20240150328-A1 METHODS AND COMPOUNDS FOR TREATING DISORDERS VHL, TFEB, BECN1 ERN1 1427/4885CYP2A6 2721/4885ALDH1A1 2034/4885
US-20140221335-A1 SUBSTITUTED BICYCLIC DIHYDROPYRIMIDINONES AND THEIR USE AS INHIBITORS OF NEUTROPHIL ELASTASE ACTIVITY SERPINB1, ELANE, MPO ERN1 1680/4885CYP2A6 1147/4885ALDH1A1 109/4885
US-20210009568-A1 METHODS AND COMPOUNDS FOR TREATING DISORDERS VHL, TFEB, BECN1 ERN1 1427/4885CYP2A6 2721/4885ALDH1A1 2034/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.